2-(2-Chloroethoxy)ethanol - ≥98% , CAS No.628-89-7

CAS: 628-89-7 Cat. No.: C118686 Fórmula: ClCH₂CH₂OCH₂CH₂OH Peso molecular: 124.57 Beilstein Registry Number: 506015 Número EC: 211-059-9

CALIDAD & PUREZA ≥98%

Synonyms

2-(2-chloro ethoxy)ethanol | EC 211-059-9 | UNII-R2UP818L4I | GS-3037 | R2UP818L4I | WLN: QZO2G | Q27287714 | LECMBPWEOVZHKN-UHFFFAOYSA- | 2-(2-chloroethoxy) ethanol | 2(2-chloroethoxy) ethanol | 2-(2-chloroethoxyl)ethanol | 2-(2-chloroethoxyl)-ethanol |

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Descripción general

2-(2-Chloroethoxy)ethanol was used in the synthesis of o-nitrophenylbromoacetaldehyde bis-2-(2-chloroethoxy)-ethyl acetal, quetiapine (an antipsychotic drug) and 2-(2-azidoethoxy)ethanol.

Especificaciones

Sinónimos

2-(2-chloro ethoxy)ethanol | EC 211-059-9 | UNII-R2UP818L4I | GS-3037 | R2UP818L4I | WLN: QZO2G | Q27287714 | LECMBPWEOVZHKN-UHFFFAOYSA- | 2-(2-chloroethoxy) ethanol | 2(2-chloroethoxy) ethanol | 2-(2-chloroethoxyl)ethanol | 2-(2-chloroethoxyl)-ethanol |

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C,Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

Pubchem Sid

508807854

Sonrisas canónicas

C(COCCCl)O

IUPAC Name

2-(2-chloroethoxy)ethanol

InChIKey

LECMBPWEOVZHKN-UHFFFAOYSA-N

INCHI

1S/C4H9ClO2/c5-1-3-7-4-2-6/h6H,1-4H2

Isómeros SMILES

C(COCCCl)O

WGK Alemania

2

RTECS

KK1350000

Peso molecular

124.57

Beilstein

506015

Reaxy-Rn

506015

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=506015&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyl ethers
• Alternative Parents: Primary alcohols Organochlorides Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dialkyl ether - Hydrocarbon derivative - Primary alcohol - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Alcohol - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Solubilidad: Miscible with water.
• Sensibilidad: Moisture and Heat sensitive
• Índice de refracción: 1.452
• Punto de inflamación (°F): 194 °F
• Punto de inflamación (°C): 90°C
• Punto de ebullición (°C): 79-81°C
• Peso molecular: 124.560 g/mol
• XLogP3: 0.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 124.029 Da
• Monoisotopic Mass: 124.029 Da
• Topological Polar Surface Area: 29.500 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 32.900
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1